N'-cyclopropyl-N',2,2-trimethylbutane-1,4-diamine

C10H22N2 — CID 65246811

IUPACN'-cyclopropyl-N',2,2-trimethylbutane-1,4-diamine
SMILESCN(CCC(C)(C)CN)C1CC1
InChIInChI=1S/C10H22N2/c1-10(2,8-11)6-7-12(3)9-4-5-9/h9H,4-8,11H2,1-3H3
InChIKeyPWSBXKNMCXPGOD-UHFFFAOYSA-N
MW170.30 g/mol
LogP1.46
Rot. Bonds5

About N'-cyclopropyl-N',2,2-trimethylbutane-1,4-diamine

N'-cyclopropyl-N',2,2-trimethylbutane-1,4-diamine (PubChem CID 65246811) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is N'-cyclopropyl-N',2,2-trimethylbutane-1,4-diamine.

Molecular Properties

Compound NameN'-cyclopropyl-N',2,2-trimethylbutane-1,4-diamine
PubChem CID65246811
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC NameN'-cyclopropyl-N',2,2-trimethylbutane-1,4-diamine
SMILESCN(CCC(C)(C)CN)C1CC1
InChIInChI=1S/C10H22N2/c1-10(2,8-11)6-7-12(3)9-4-5-9/h9H,4-8,11H2,1-3H3
InChIKeyPWSBXKNMCXPGOD-UHFFFAOYSA-N
XLogP1.46
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N'-(1-ethylpiperidin-4-yl)-N',2,2-trimethylbutane-1,4-diamine
CID 65246884
N-[2-(3-amino-2,2-dimethylpropoxy)ethyl]-N-methylcyclopropanamine
CID 102741076
N',N',2,2-tetramethylbutane-1,4-diamine
CID 65250173
N',N'-bis(cyclopropylmethyl)-2,2-dimethylbutane-1,4-diamine
CID 65247386
N'-ethyl-N',2,2-trimethylbutane-1,4-diamine
CID 65246754
4-N-(3,3-dimethylbutyl)-1-N,4-N-dimethylcyclohexane-1,4-diamine
CID 79122136
N-cyclobutyl-N,2,2-trimethylbutane-1,4-diamine
CID 115204377
N',2,2-trimethyl-N'-propylbutane-1,4-diamine
CID 65246982
N'-cyclopropyl-N'-methylhexane-1,6-diamine
CID 43265095
N'-cyclopropyl-2,2-dimethyl-N'-(3-methylbutyl)pentane-1,5-diamine
CID 79005112
3-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]-2,2-dimethylpropanamide;dihydrochloride
CID 119863852
N',2,2-trimethyl-N'-(oxolan-2-ylmethyl)butane-1,4-diamine
CID 65246933

Frequently Asked Questions

What is the IUPAC name of N'-cyclopropyl-N',2,2-trimethylbutane-1,4-diamine?
The IUPAC name of N'-cyclopropyl-N',2,2-trimethylbutane-1,4-diamine (CID 65246811) is N'-cyclopropyl-N',2,2-trimethylbutane-1,4-diamine.
What is the SMILES notation for N'-cyclopropyl-N',2,2-trimethylbutane-1,4-diamine?
The canonical SMILES for N'-cyclopropyl-N',2,2-trimethylbutane-1,4-diamine is CN(CCC(C)(C)CN)C1CC1.
What is the InChIKey of N'-cyclopropyl-N',2,2-trimethylbutane-1,4-diamine?
The InChIKey is PWSBXKNMCXPGOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2/c1-10(2,8-11)6-7-12(3)9-4-5-9/h9H,4-8,11H2,1-3H3.
What are the key properties of N'-cyclopropyl-N',2,2-trimethylbutane-1,4-diamine?
N'-cyclopropyl-N',2,2-trimethylbutane-1,4-diamine has a molecular weight of 170.30 g/mol, XLogP of 1.46, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopropyl-N',2,2-trimethylbutane-1,4-diamine is sourced from PubChem (CID 65246811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).